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fix energy grid w/ rotation & charges #239

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wants to merge 6 commits into from
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fix energy grid w/ rotation & charges #239

wants to merge 6 commits into from

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eahenle
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@eahenle eahenle commented Jun 24, 2024

closes #235

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eahenle commented Jun 24, 2024

Thanks @qlx17

@SimonEnsemble this is good to merge

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eahenle commented Jun 26, 2024

merging to v0.5-rc branch

@eahenle eahenle closed this Jun 26, 2024
@eahenle eahenle deleted the fix-235 branch June 26, 2024 22:08
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Error when computing energy grid for rotatable molecules in a charged crystal
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